In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2010 | 21 | Yes |
Popular Name: (2S)-N-methyl-2-phenyl-2-[3-(trifluoromethyl)phenoxy]ethanamine (2S)-N-methyl-2-phenyl-2-[3-(tri…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 4.23 | 9.09 | -45.82 | 2 | 2 | 1 | 26 | 296.312 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.23 | 7.83 | -3.99 | 1 | 2 | 0 | 21 | 295.304 | 6 | ↓ |